化学式

CAS号

IUPAC Name

1-环丙基-6-[3-[(E)-[(1R,2R,5S,7R,8R,9R,11R,13S,14R)-8-[(2S,3R,4S,6R)-4-(二甲基氨基)-3-羟基-6-methyloxan-2-基]氧基-2-乙基-5-氟-9-甲氧基-1,5,7,9,11,13-六甲基-4,6,16-三氧代-3,15,17-trioxabicyclo[12.3.0]十七烷-12-亚基]氨基]oxyprop-1-丙炔]-N-甲基-4-羟基-3-羧酰胺 1-cyclopropyl-6-[3-[(E)-[(1R,2R,5S,7R,8R,9R,11R,13S,14R)-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-5-fluoro-9-methoxy-1,5,7,9,11,13-hexamethyl-4,6,16-trioxo-3,15,17-trioxabicyclo[12.3.0]heptadecan-12-ylidene]amino]oxyprop-1-ynyl]-N-methyl-4-oxoquinoline-3-carboxamide

InChI

InChI=1S/C48H65FN4O13/c1-13-35-48(8)41(65-45(59)66-48)27(4)36(51-61-20-14-15-29-16-19-33-31(22-29)37(54)32(42(57)50-9)24-53(33)30-17-18-30)25(2)23-46(6,60-12)40(28(5)39(56)47(7,49)44(58)63-35)64-43-38(55)34(52(10)11)21-26(3)62-43/h16,19,22,24-28,30,34-35,38,40-41,43,55H,13,17-18,20-21,23H2,1-12H3,(H,50,57)/b51-36+/t25-,26-,27+,28+,34+,35-,38-,40-,41-,43+,46-,47+,48-/m1/s1

InChI Key

SKLUGUNEXOLAMD-SOXJWNHKSA-N

Canonical SMILES

CCC1C2(C(C(C(=NOCC#CC3=CC4=C(C=C3)N(C=C(C4=O)C(=O)NC)C5CC5)C(CC(C(C(C(=O)C(C(=O)O1)(C)F)C)OC6C(C(CC(O6)C)N(C)C)O)(C)OC)C)C)OC(=O)O2)C

别名

• CHEMBL4557944